N-methyl-L-valyl-L-tryptophanol

Properties Image MNX_ID MNXM1100817 reference chebi:192685 formula C17H26N3O2 global charge 1 mol weight 304.414 InChIKey OQYFURUBPANIIX-BBRMVZONSA-O InChI InChI=1S/C17H25N3O2/c1-11(2)16(18-3)17(22)20-13(10-21)8-12-9-19-15-7-5-4-6-14(12)15/h4-7,9,11,13,16,18-19,21H,8,10H2,1-3H3,(H,20,22)/p+1/t13-,16-/m0/s1 SMILES C[NH2+][C@H](C(=O)N[C@H](CO)CC1=CNC2=CC=CC=C12)C(C)C MNX internals InChI (mnx) InChI=1/C17H25N3O2/c1-11(2)16(18-3)17(22)20-13(10-21)8-12-9-19-15-7-5-4-6-14(12)15/h4-7,9,11,13,16,18-19,21H,8,10H2,1-3H3,(H,20,22)/t13-,16-/m0/s1 SMILES (mnx) [CH3:1][CH:11]([CH3:2])[C@@H:16]([C:17](=[N:20][C@@H:13]([CH2:8][C:12]1=[CH:9][NH:19][C:15]2=[CH:7][CH:5]=[CH:4][CH:6]=[C:14]12)[CH2:10][OH:21])[OH:22])[NH:18][CH3:3]

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 3 in models (compartimentalized) 0